4-Chloro-6-ethenyl-5-fluoropyrimidine
Grundinformationen
- CAS
1403893-61-7- Standard-SMILES
C=Cc1ncnc(Cl)c1F- InChIKey
OOPSUAVKHZVJLT-UHFFFAOYSA-N- Summenformel
- C6H4ClFN2
- Durchschnittliche Molmasse
- 158,56 g/mol
- Monoisotopische Masse
- 158,004704
Namen und Bezeichner
- Bevorzugter Name
- 4-Chloro-6-ethenyl-5-fluoropyrimidine
- IUPAC
- 4-chloro-6-ethenyl-5-fluoropyrimidine
- Englischer Name
- 4-chloro-5-fluoro-6-vinylpyriMidine
- Summenformel
- C6H4ClFN2
- Molmasse
- 158.56
Namen und Synonyme
4-Chloro-5-fluoro-6-vinylpyrimidine1403893-61-74-CHLORO-6-ETHENYL-5-FLUOROPYRIMIDINEDTXSID101287664RefChem:521588DTXCID501718312940-222-3Pyrimidine, 4-chloro-6-ethenyl-5-fluoro-Voriconazole Impurity 34S7JHN785KQSCHEMBL15649019WLZ3568
Weitere Namen anzeigen
Voriconazole Impurity 32Azilsartan medoxomil impurity313(2S,3R)-2-(2,4-difluorophenyl)-3-(5-fluoro-6-(1-(5-fluoropyrimidin-4-yl)ethyl)pyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
OOPSUAVKHZVJLT-UHFFFAOYSA-N4-Chloro-5-fluoro-6-vinyl pyrimidineSB56075DS-001389
Datenbank-Bezeichner
- CAS
1403893-61-7- PubChem CID
- 73672883
- DTXSID
DTXSID101287664- UNII
- S7JHN785KQ
- EC Number
- 940-222-3
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 25,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 131
Physikochemische Eigenschaften
- Siedepunkt
- 233.9 · 233.9±40.0 °C(Predicted)
- Dichte
- 1.343 · 1.343±0.06 g/cm3(Predicted)
- Dampfdruck
- 1.04 · 1.04-1.733hPa at 20-25℃
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -1.39 · -1.39±0.26(Predicted)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P260, P261, P264, P270, P272, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 03-12-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/29376
Hazard Classes and CategoriesAcute Tox. 2 (100%)；Skin Corr. 1B (100%)；Skin Sens. 1 (100%)
Regulatorische Informationen
Regulatory InformationStatus: Active Update: 03-12-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/29376
Sicherheitsdaten
- Alarmwort
- Achtung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H300
Chemie und Industrie
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